SCHEMBL3705115

SCHEMBL3705115

CCCCC=CCCCCCCCCCC(=O)OC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.73
F7 P08709 2/20 0.63
F3 P13726 2/20 0.63
LMNA P02545 2/20 0.61
ALDH1A1 P00352 1/20 0.61
CNR2 P34972 1/20 0.59
TERT O14746 3/20 0.58
PTPN1 P18031 3/20 0.58
PPARG P37231 3/20 0.58
PPARD Q03181 3/20 0.58
PPARA Q07869 3/20 0.58
CYP1A2 P05177 2/20 0.58
MAPT P10636 2/20 0.58
CYP2C19 P33261 2/20 0.58
BLM P54132 2/20 0.58
HSD17B10 Q99714 2/20 0.58
FABP4 P15090 2/20 0.58
FAAH O00519 2/20 0.58
KMT2A Q03164 2/20 0.58
GMNN O75496 1/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28248477 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL10444384 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL28495765 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL583629 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL2029804 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL28813484 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL583630 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL30801443 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL31512544 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1
SCHEMBL28344532 1.00 EPHX2 (0.73) EPHX2F7F3LMNAALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1047378-C Method for synthesizing sex information hormone of bollworm UNIV BEIJING POLYTECHNIC (CN) 1999-12-15 CN claimed
CN-1169416-A Method for synthesizing sex information hormone of bollworm BEIJING POLYTECHNIQUE UNIV (CN) 1998-01-07 CN claimed
CN-116098279-A Matcha flavor imparting composition 长谷川香料株式会社 2023-05-12 CN disclosed
CN-116103086-A Tea flavor imparting composition 长谷川香料株式会社 2023-05-12 CN disclosed
US-11332694-B2 Pyrrole compound, method of making same, and aroma composition, food, drink and cosmetics containing same T. HASEGAWA CO., LTD. (JP) 2022-05-17 US disclosed
US-20200157463-A1 PYRROLE COMPOUND, AROMA COMPOSITION, AND FOOD AND DRINK AND COSMETICS CONTAINING THE SAME T. HASEGAWA CO., LTD. (JP) 2020-05-21 US disclosed
CN-110869348-A Pyrrole compound, perfume composition, and food, drink and cosmetic containing same 长谷川香料株式会社 2020-03-06 CN disclosed
WO-2010081335-A1 A method of producing biofuel using sugarcane as feedstock TSINGHUA UNIVERSITY (CN) 2010-07-22 WO disclosed
CN-1047378-C Method for synthesizing sex information hormone of bollworm UNIV BEIJING POLYTECHNIC (CN) 1999-12-15 CN disclosed
CN-1169416-A Method for synthesizing sex information hormone of bollworm BEIJING POLYTECHNIQUE UNIV (CN) 1998-01-07 CN disclosed
WO-1995009630-A1 COMPOUNDS EXHIBITING ANTIPROLIFERATIVE ACTIVITY AGAINST CELLS THE STATE OF OREGON ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 1995-04-13 WO disclosed
US-5324739-A Curacin A and Curacin B isomers; antimitotics STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 1994-06-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200157463-A1 PYRROLE COMPOUND, AROMA COMPOSITION, AND FOOD AND DRINK AND COSMETICS CONTAINING THE SAME TAS1R1, TAS2R1, TAS1R2 EPHX2 4198/4885F7 3227/4885F3 2338/4885
US-11332694-B2 Pyrrole compound, method of making same, and aroma composition, food, drink and cosmetics containing same TAS2R1, TAS1R1, TAS2R10 EPHX2 3094/4885F7 2053/4885F3 3012/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.